4-bromo-3-(4-methylpiperazine-1-sulfonyl)-N-(3-nitrophenyl)benzamide
Chemical Structure Depiction of
4-bromo-3-(4-methylpiperazine-1-sulfonyl)-N-(3-nitrophenyl)benzamide
4-bromo-3-(4-methylpiperazine-1-sulfonyl)-N-(3-nitrophenyl)benzamide
Compound characteristics
| Compound ID: | 2552-0148 |
| Compound Name: | 4-bromo-3-(4-methylpiperazine-1-sulfonyl)-N-(3-nitrophenyl)benzamide |
| Molecular Weight: | 483.34 |
| Molecular Formula: | C18 H19 Br N4 O5 S |
| Smiles: | CN1CCN(CC1)S(c1cc(ccc1[Br])C(Nc1cccc(c1)[N+]([O-])=O)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.8499 |
| logD: | 2.2982 |
| logSw: | -3.5868 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 91.899 |
| InChI Key: | ORQZKWGOAOLKNE-UHFFFAOYSA-N |